# generated using pymatgen
data_Fe2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.06545576
_cell_length_b   16.26111290
_cell_length_c   48.97542371
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2P
_chemical_formula_sum   'Fe60 P30'
_cell_volume   2441.31331975
_cell_formula_units_Z   30
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Fe  Fe1  1  1.002322  0.487661  0.343806  1
  Fe  Fe2  1  1.002322  0.855454  0.305629  1
  Fe  Fe3  1  1.002322  0.097358  0.322125  1
  Fe  Fe4  1  1.002322  0.745810  0.357006  1
  Fe  Fe5  1  1.002322  0.285057  0.320218  1
  Fe  Fe6  1  1.002322  0.942893  0.360216  1
  Fe  Fe7  1  0.502322  0.611562  0.358644  1
  Fe  Fe8  1  0.502322  0.971636  0.319534  1
  Fe  Fe9  1  0.502322  0.548589  0.304614  1
  Fe  Fe10  1  0.502322  0.195308  0.347316  1
  Fe  Fe11  1  0.502322  0.364240  0.355848  1
  Fe  Fe12  1  0.502322  0.729898  0.311810  1
  Fe  Fe13  1  1.002322  0.775045  0.428777  1
  Fe  Fe14  1  1.002322  0.131999  0.387064  1
  Fe  Fe15  1  1.002322  0.390768  0.399375  1
  Fe  Fe16  1  1.002322  0.032693  0.441389  1
  Fe  Fe17  1  1.002322  0.577475  0.401077  1
  Fe  Fe18  1  1.002322  0.221986  0.444544  1
  Fe  Fe19  1  0.502322  0.898459  0.443591  1
  Fe  Fe20  1  0.502322  0.255275  0.402692  1
  Fe  Fe21  1  0.502322  0.837217  0.388717  1
  Fe  Fe22  1  0.502322  0.481665  0.429383  1
  Fe  Fe23  1  0.502322  0.651143  0.439283  1
  Fe  Fe24  1  0.502322  0.008427  0.400298  1
  Fe  Fe25  1  1.002322  0.062332  0.513084  1
  Fe  Fe26  1  1.002322  0.419257  0.470496  1
  Fe  Fe27  1  1.002322  0.675694  0.482308  1
  Fe  Fe28  1  1.002322  0.318063  0.524679  1
  Fe  Fe29  1  1.002322  0.864104  0.485243  1
  Fe  Fe30  1  1.002322  0.507487  0.526348  1
  Fe  Fe31  1  0.502322  0.182768  0.527187  1
  Fe  Fe32  1  0.502322  0.540608  0.484612  1
  Fe  Fe33  1  0.502322  0.124030  0.472316  1
  Fe  Fe34  1  0.502322  0.767627  0.512801  1
  Fe  Fe35  1  0.502322  0.937753  0.523583  1
  Fe  Fe36  1  0.502322  0.294572  0.481798  1
  Fe  Fe37  1  1.002322  0.348452  0.594851  1
  Fe  Fe38  1  1.002322  0.704853  0.552887  1
  Fe  Fe39  1  1.002322  0.959817  0.567187  1
  Fe  Fe40  1  1.002322  0.604565  0.605507  1
  Fe  Fe41  1  1.002322  0.148924  0.569256  1
  Fe  Fe42  1  1.002322  0.795300  0.609581  1
  Fe  Fe43  1  0.502322  0.466883  0.608849  1
  Fe  Fe44  1  0.502322  0.829098  0.568579  1
  Fe  Fe45  1  0.502322  0.408886  0.554673  1
  Fe  Fe46  1  0.502322  0.053033  0.597752  1
  Fe  Fe47  1  0.502322  0.223765  0.607226  1
  Fe  Fe48  1  0.502322  0.580378  0.563823  1
  Fe  Fe49  1  1.002322  0.621882  0.676155  1
  Fe  Fe50  1  1.002322  0.991521  0.640460  1
  Fe  Fe51  1  1.002322  0.242560  0.653415  1
  Fe  Fe52  1  1.002322  0.874332  0.690941  1
  Fe  Fe53  1  1.002322  0.440869  0.652758  1
  Fe  Fe54  1  1.002322  0.094446  0.692129  1
  Fe  Fe55  1  0.502322  0.743351  0.693912  1
  Fe  Fe56  1  0.502322  0.112837  0.652871  1
  Fe  Fe57  1  0.502322  0.694833  0.636024  1
  Fe  Fe58  1  0.502322  0.352935  0.681489  1
  Fe  Fe59  1  0.502322  0.503453  0.689516  1
  Fe  Fe60  1  0.502322  0.865042  0.648966  1
  P  P61  1  0.502322  0.192392  0.298049  1
  P  P62  1  0.502322  0.844420  0.342244  1
  P  P63  1  0.502322  0.406748  0.311810  1
  P  P64  1  0.502322  0.058187  0.357466  1
  P  P65  1  1.002322  0.630625  0.325756  1
  P  P66  1  1.002322  0.995965  0.285389  1
  P  P67  1  0.502322  0.485130  0.381142  1
  P  P68  1  0.502322  0.130209  0.424645  1
  P  P69  1  0.502322  0.699422  0.395581  1
  P  P70  1  0.502322  0.344789  0.438020  1
  P  P71  1  0.002322  0.913283  0.410216  1
  P  P72  1  0.002322  0.271952  0.369964  1
  P  P73  1  0.502322  0.771809  0.465107  1
  P  P74  1  0.502322  0.414512  0.507081  1
  P  P75  1  0.502322  0.986856  0.479976  1
  P  P76  1  0.502322  0.629860  0.520389  1
  P  P77  1  1.002322  0.200483  0.494109  1
  P  P78  1  0.002322  0.557444  0.451425  1
  P  P79  1  0.502322  0.056882  0.549784  1
  P  P80  1  0.502322  0.702000  0.589127  1
  P  P81  1  0.502322  0.271077  0.563041  1
  P  P82  1  0.502322  0.917383  0.606061  1
  P  P83  1  1.002322  0.486271  0.576064  1
  P  P84  1  1.002322  0.843382  0.535079  1
  P  P85  1  0.502322  0.341451  0.632548  1
  P  P86  1  0.502322  0.983123  0.678443  1
  P  P87  1  0.502322  0.558150  0.643334  1
  P  P88  1  0.502322  0.210159  0.690596  1
  P  P89  1  1.002322  0.766150  0.658762  1
  P  P90  1  0.002322  0.129987  0.619209  1
